4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=9.89261240155 stress="-13.613299865182416 3.1534652340450973 0.7872003942421848 3.1534652340450973 -12.518821734921401 2.536711824433367 0.7872003942421848 2.536711824433367 -15.51694109263097" pbc="F F F" U -0.25354363 -0.01806569 -0.07998135 -13.45977112 -15.02143056 -13.30410742 U 1.70070203 1.20342959 -0.09914834 18.08117959 20.35786546 -37.09719418 U 1.49793547 0.28187239 1.51001192 23.24549921 -36.07329287 37.32232337 U -0.01546661 1.60170120 1.37793365 -27.86690769 30.73685797 13.07897823